5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one

C13H18N2O3 — CID 43114062

IUPAC5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1ccc(=O)[nH]c1)N1CCCCC1CCO
InChIInChI=1S/C13H18N2O3/c16-8-6-11-3-1-2-7-15(11)13(18)10-4-5-12(17)14-9-10/h4-5,9,11,16H,1-3,6-8H2,(H,14,17)
InChIKeyQTMLUNTWUDDFEN-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.75
Rot. Bonds3

About 5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one

5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 43114062) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
PubChem CID43114062
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1ccc(=O)[nH]c1)N1CCCCC1CCO
InChIInChI=1S/C13H18N2O3/c16-8-6-11-3-1-2-7-15(11)13(18)10-4-5-12(17)14-9-10/h4-5,9,11,16H,1-3,6-8H2,(H,14,17)
InChIKeyQTMLUNTWUDDFEN-UHFFFAOYSA-N
XLogP0.75
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxycyclohexyl)-6-oxo-1H-pyridine-3-carboxamide
CID 28826307
(4-Hydroxypiperidin-1-yl)(6-hydroxypyridin-3-yl)methanone
CID 28831698
5-[(2S,6R)-2,6-dimethylpiperidine-1-carbonyl]-1H-pyridin-2-one
CID 28942575
5-(2,6-dimethylpiperidine-1-carbonyl)-1H-pyridin-2-one
CID 43120480
5-(4-(hydroxymethyl)piperidine-1-carbonyl)pyridin-2(1H)-one
CID 43133357
5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one
CID 43212824
5-[2-(hydroxymethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 43421558
(3-(Hydroxymethyl)piperidin-1-yl)(6-hydroxypyridin-3-yl)methanone
CID 43422378
N-(3-hydroxycyclohexyl)-6-oxo-1H-pyridine-3-carboxamide
CID 53529023
6-hydroxy-4-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 54878527
2-[1-(6-oxo-1H-pyridine-3-carbonyl)piperidin-2-yl]acetic acid
CID 54899615
N-cyclohexyl-N-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide
CID 54942984

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one (CID 43114062) is 5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one is O=C(c1ccc(=O)[nH]c1)N1CCCCC1CCO.
What is the InChIKey of 5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is QTMLUNTWUDDFEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c16-8-6-11-3-1-2-7-15(11)13(18)10-4-5-12(17)14-9-10/h4-5,9,11,16H,1-3,6-8H2,(H,14,17).
What are the key properties of 5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 250.30 g/mol, XLogP of 0.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 43114062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).